PUBCHEM-ZINC05850853 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 1.0540 1.9420 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 0.7480 -0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -0.3970 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 -0.3570 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 0.8480 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 1.9920 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 -1.5960 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 -2.1310 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 -3.0850 -2.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 -1.4400 -2.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2470 -1.7990 -3.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6370 -2.4250 -3.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2020 -2.6930 -4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6300 -3.2410 -4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3400 -3.3200 -6.1810 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2440 -2.3780 -6.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8440 -3.5730 -5.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2300 -4.7570 -6.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8210 -4.4100 -7.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7320 -4.3420 -7.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0470 -3.3350 -8.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4340 -5.6510 -8.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4090 -5.5190 -10.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5980 -5.5790 -10.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5730 -5.4630 -12.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3610 -5.2830 -12.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1730 -5.2080 -12.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1970 -5.3200 -10.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 2.8330 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 0.7070 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -1.3220 -1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 0.9070 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 2.9220 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 -1.4020 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 -2.3780 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2200 -0.6380 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 -2.4850 -4.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 -0.8730 -4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 -1.7520 -2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5950 -3.3590 -2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5520 -3.4090 -5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1970 -1.7630 -5.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2030 -2.5920 -4.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6080 -4.2330 -4.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3980 -5.2500 -6.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1600 -6.4240 -8.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4640 -6.0100 -8.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5530 -5.7170 -10.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5010 -5.5130 -12.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3430 -5.1940 -13.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 -5.0580 -12.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2660 -5.2480 -10.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4840 -2.5900 -5.3770 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 17 18 2 0 0 0 0 17 53 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 M CHG 1 53 -1 M END